(2R)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]azepan-1-ium

Systemtic Name: (2R)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]azepan-1-ium Openeye Name: (2R)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]azepan-1-ium CAS Name: (2R)-2-[(4-methyl-1-piperidin-1-iumyl)methyl]azepan-1-ium IUPAC Name: (2R)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]azepan-1-ium Traditional Name: (2R)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]azepan-1-ium Formula: C13H28N2+2 MolecularWeight: 212.37482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2CCCCC[NH2+]2

Isomeric SMILES

CC1CC[NH+](CC1)C[C@H]2CCCCC[NH2+]2

InChI

InChI=1S/C13H26N2/c1-12-6-9-15(10-7-12)11-13-5-3-2-4-8-14-13/h12-14H,2-11H2,1H3/p+2/t13-/m1/s1